1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-phenyl-thiourea

Systemtic Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-phenyl-thiourea Openeye Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-phenyl-thiourea CAS Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-phenylthiourea IUPAC Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-phenylthiourea Traditional Name: 1-(2-cyanoethyl)-3-(4-methoxyphenyl)-1-phenyl-thiourea Formula: C17H17N3OS MolecularWeight: 311.40138

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N(CCC#N)C2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N(CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C17H17N3OS/c1-21-16-10-8-14(9-11-16)19-17(22)20(13-5-12-18)15-6-3-2-4-7-15/h2-4,6-11H,5,13H2,1H3,(H,19,22)